N-[(1S,2R)-1-(4-bromophenyl)-2-methyl-3-morpholin-4-yl-3-oxidanylidene-propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1S,2R)-1-(4-bromophenyl)-2-methyl-3-morpholin-4-yl-3-oxidanylidene-propyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S,2R)-1-(4-bromophenyl)-2-methyl-3-morpholino-3-oxo-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1S,2R)-1-(4-bromophenyl)-2-methyl-3-(4-morpholinyl)-3-oxopropyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1S,2R)-1-(4-bromophenyl)-2-methyl-3-morpholin-4-yl-3-oxopropyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S,2R)-1-(4-bromophenyl)-3-keto-2-methyl-3-morpholino-propyl]-4-methyl-benzenesulfonamide Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=C(C=C2)Br)C(C)C(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C2=CC=C(C=C2)Br)[C@@H](C)C(=O)N3CCOCC3

InChI

InChI=1S/C21H25BrN2O4S/c1-15-3-9-19(10-4-15)29(26,27)23-20(17-5-7-18(22)8-6-17)16(2)21(25)24-11-13-28-14-12-24/h3-10,16,20,23H,11-14H2,1-2H3/t16-,20+/m1/s1